Thermodynamic consideration of binary vapor liquid equilibria
Thermodynamic analysis of binary vapor liquid equilibria
THERMODYNAMIC EQUILIBRIUM↗
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Results for “BINARY FLUID”
Search indexed NASA NTRS and DOE OSTI research on propulsion, heat transfer, battery materials and energy systems. Follow report and document links to the original sources.
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Binary correlations in a stable homogeneous plasma.
Pair correlations function in stable homogeneous plasma
PLASMA STABILITY↗
High pressure cosmochemistry applied to major planetary interiors: Experimental studies
The measurement of equilibria in binary fluid-solid systems in diamond anvil cells, represents a major advance of the art of high-pressure experimentation. Vibrational spectroscopy, direct visual observations, and X-ray diffraction crystallography of materials confined in externally heated cells are the primary experimental probes being used. Adiabats in these systems are being measured in order to constrain models of heat flow in these bodies and to detect phase transitions by thermal anomalies. Other studies are directed toward interpreting high pressure reactions in these systems that are suggested by shockwave measurements, and developing methods for reaching high temperatures and high pressures of planetary interest in diamond cells. The overall objective of this project is to determine the properties of the H2-He-H2O-HN3-CH4 system and related small-molecule systems that are needed to constrain theoretical models of the interiors of the major planets.
Nicol, M. F.↗
High pressure cosmochemistry applied to major planetary interiors: Experimental studies
The overall goal of this project is to determine properties of the H-He-C-N-O system, as represented by small molecules composed of these elements, that are needed to constrain theoretical models of the interiors of the major planets. Much of our work now concerns the H2O-NH3 system. This project is the first major effort to measure phase equilibria in binary fluid-solid systems in diamond anvil cells. Vibrational spectroscopy, direct visual observations, and X-ray crystallography of materials confined in externally heated cells are our primary experimental probes. We also are collaborating with the shockwave physics group at Lawrence Livermore Laboratory in studies of the equation of state of a synthetic Uranus fluid and molecular composition of this and other H-C-N-O materials under planetary conditions.
Nicol, M. F.↗
Growth and Morphology of Phase Separating Supercritical Fluids
The scientific objective is to study the relation between the morphology and the growth kinetics of domains during phase separation. We know from previous experiments performed near the critical point of pure fluids and binary liquids that there are two simple growth laws at late times. The 'fast' growth appears when the volumes of the phases are nearly equal and the droplet pattern is interconnected. In this case the size of the droplets grows linearly in time. The 'slow' growth appears when the pattern of droplets embedded in the majority phase is disconnected. In this case the size of the droplets increases in proportion to time to the power 1/3. The volume fraction of the minority phase is a good candidate to determine this change of behavior. All previous attempts to vary the volume fraction in a single experimental cell have failed because of the extreme experimental difficulties.
Hegseth, John↗
A Validated All-Pressure Fluid Drop Model and Lewis Number Effects for a Binary Mixture
The differences between subcritical liquid drop and supercritical fluid drop behavior are discussed. Under subcritical, evaporative high emission rate conditions, a film layer is present in the inner part of the drop surface which contributes to the unique determination of the boundary conditions; it is this film layer which contributes to the solution's convective-diffusive character. In contrast, under supercritical condition as the boundary conditions contain a degree of arbitrariness due to the absence of a surface, and the solution has then a purely diffusive character. Results from simulations of a free fluid drop under no-gravity conditions are compared to microgravity experimental data from suspended, large drop experiments at high, low and intermediary temperatures and in a range of pressures encompassing the sub-and supercritical regime. Despite the difference between the conditions of the simulations and experiments (suspension vs. free floating), the time rate of variation of the drop diameter square is remarkably well predicted in the linear curve regime. The drop diameter is determined in the simulations from the location of the maximum density gradient, and agrees well with the data. It is also shown that the classical calculation of the Lewis number gives qualitatively erroneous results at supercritical conditions, but that an effective Lewis number previously defined gives qualitatively correct estimates of the length scales for heat and mass transfer at all pressures.
Harstad, K.↗
A Validated All-Pressure Fluid Drop Model and Lewis Number Effects for a Binary Mixture
The differences between subcritical liquid drop and supercritical fluid drop behavior are discussed.
All-pressure↗
An instability due to the nonlinear coupling of p-modes to g-modes: Implications for coalescing neutron star binaries
A weakly nonlinear fluid wave propagating within a star can be unstable to three-wave interactions. The resonant parametric instability is a well-known form of three-wave interaction in which a primary wave of frequency ω {sub a} excites a pair of secondary waves of frequency ω {sub b} + ω {sub c} ≅ ω {sub a}. Here we consider a nonresonant form of three-wave interaction in which a low-frequency primary wave excites a high-frequency p-mode and a low-frequency g-mode such that ω {sub b} + ω {sub c} >> ω {sub a}. We show that a p-mode can couple so strongly to a g-mode of similar radial wavelength that this type of nonresonant interaction is unstable even if the primary wave amplitude is small. As an application, we analyze the stability of the tide in coalescing neutron star binaries to p-g mode coupling. We find that the equilibrium tide and dynamical tide are both p-g unstable at gravitational wave frequencies f {sub gw} ≳ 20 Hz and drive short wavelength p-g mode pairs to significant energies on very short timescales (much less than the orbital decay time due to gravitational radiation). Resonant parametric coupling to the tide is, by contrast, either stable or drives modes at a much smaller rate. We do not solve for the saturation of the p-g instability and therefore we cannot say precisely how it influences the evolution of neutron star binaries. However, we show that if even a single daughter mode saturates near its wave breaking amplitude, the p-g instability of the equilibrium tide will (1) induce significant orbital phase errors (Δφ ≳ 1 radian) that accumulate primarily at low frequencies (f {sub gw} ≲ 50 Hz) and (2) heat the neutron star core to a temperature of T ∼ 10{sup 10} K. Since there are at least ∼100 unstable p-g daughter pairs, Δφ and T are potentially much larger than these values. Tides might therefore significantly influence the gravitational wave signal and electromagnetic emission from coalescing neutron star binaries at much larger orbital separations than previously thought.
79 ASTRONOMY AND ASTROPHYSICS↗
Contact angles from Young’s equation in molecular dynamics simulations
In this work, we propose a method to calculate the equilibrium contact angle of heterogeneous 3-phase solid/fluid/fluid systems using molecular dynamics simulations. The proposed method, which combines the phantom-wall method [F. Leroy and F. Müller-Plathe, J. Chem. Phys. 133, 044110 (2010)] and Bennett’s acceptance ratio approach [C. H. Bennett, J. Comput. Phys. 22, 245 (1976)], is able to calculate the solid/fluid surface tension relative to the solid surface energy. The calculated relative surface tensions can then be used in Young’s equation to estimate the equilibrium contact angle. A fluid droplet is not needed for the proposed method, in contrast to the situation for direct simulations of contact angles. In addition, while prior free-energy based methods for contact angles mainly focused on the wetting of fluids in coexistence with their vapor on solid surfaces, the proposed approach was designed to study the contact angles of fluid mixtures on solid surfaces above the fluid saturation pressures. Using the proposed approach, the contact angles of binary Lennard-Jones fluid mixtures on a non-polar solid substrate were calculated at various interaction parameters and the contact angle of water in equilibrium with CO 2 on a hydrophilic polar silica surface was obtained. For both non-polar and polar systems, the calculated contact angles from the proposed method were in agreement with those obtained from the geometry of a cylindrical droplet. The computational cost of the proposed method was found to be comparable to that of simulations that use fluid droplets, but the new method provides a way to calculate the contact angle directly from Young’s equation without ambiguity.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗
Binary Power Plant CO2 Life Cycle Emissions Including Isobutane Fugitive Emission
Geothermal energy production has one of the lowest life cycle CO2 emission factors (~ 15 g-CO2/kWh) for plants producing electricity (Hondo, 2005). This life cycle factor includes indirect emissions from plant construction as well as ongoing operations such as additional well drilling and equipment replacement. Not included in this calculation are direct emissions from geothermal power production. Geothermal flash plants emit CO2 at rates related to the reservoir concentration. Binary plants report “near zero” emissions of high global warming potential gases because of their closed loop system design. Binary plants use working fluids to drive the turbine generators and leakage of these working fluids have not yet been quantified. To assess the working fluid emissions from geothermal power production using an Organic Rankine Cycle, reported isobutane emissions were accessed for 3 California binary plants from the Great Basin Unified and Imperial County Air Pollution Control Districts as well as the California Air Resource Board. Each binary plant used in this study has been operating for more than 25 years. From the data, two types of isobutane emissions were accounted for over a 15 month period: ‘normal’ equipment leakage and equipment breakdown emissions. This preliminary analysis of working fluid emissions from these plants suggest that if a binary plant has equipment failures, the majority of the isobutane releases can be due to these events. The results indicate that a well maintained binary plant releases approximately 0.13 g-Isobutane/kWh where as a plant with equipment failures releases approximately 6 g-Isobutane/kWh. Assuming a greenhouse warming potential of 3 for isobutane, these emission values become 0.4 and 18 g-CO2e/kWh (where CO2e is the CO2 equivalent effect). The direct operation isobutane leakage for a well maintained binary plant does not significant increase the life cycle CO2 emission factor whereas a plant with significant equipment issues can effectively double the life cycle CO2 emissions. This limited data set suggests that when direct CO2e fugitive emission are add to the indirect CO2 emissions, the total CO2 emissions from binary power plants are equivalent or less than nuclear, as well as other renewables power production such as wind and solar.
15 GEOTHERMAL ENERGY↗
High Temperature Variable Conductance Heat Pipes for Radioisotope Stirling Systems
In a Stirling radioisotope system, heat must continually be removed from the GPHS modules, to maintain the GPHS modules and surrounding insulation at acceptable temperatures. Normally, the Stirling convertor provides this cooling. If the Stirling convertor stops in the current system, the insulation is designed to spoil, preventing damage to the GPHS, but also ending the mission. An alkali-metal Variable Conductance Heat Pipe (VCHP) is under development to allow multiple stops and restarts of the Stirling convertor. The status of the ongoing effort in developing this technology is presented in this paper. An earlier, preliminary design had a radiator outside the Advanced Stirling Radioisotope Generator (ASRG) casing, used NaK as the working fluid, and had the reservoir located on the cold side adapter flange. The revised design has an internal radiator inside the casing, with the reservoir embedded inside the insulation. A large set of advantages are offered by this new design. In addition to reducing the overall size and mass of the VCHP, simplicity, compactness and easiness in assembling the VCHP with the ASRG are significantly enhanced. Also, the permanently elevated temperatures of the entire VCHP allows the change of the working fluid from a binary compound (NaK) to single compound (Na). The latter, by its properties, allows higher performance and further mass reduction of the system. Preliminary design and analysis shows an acceptable peak temperature of the ASRG case of 140 C while the heat losses caused by the addition of the VCHP are 1.8 W.
Tarau, Calin↗
A high temperature Rankine binary cycle for ground and space solar engine applications
A Rankine cycle covering the range of plasma temperatures possible from a solar radiation boiler is studied. The working fluid is potassium. A binary cycle with potassium as the topping cycle fluid and a conventional steam cycle as the bottoming cycle for earth-based applications is analyzed. Operation in conjunction with a wave energy exchanger is considered.
Hertzberg, A.↗
Optical studies of a binary miscibility gap system
Model transparent fluids are being studied to develop a better understanding of phase separation processes in binary miscibility-gap metal alloys. The model selected for the reported work is diethylene glycol-ethyl salicylate. This system is well characterized with respect to its phase diagram, density, surface and interfacial tensions, viscosity, and other pertinent physical properties. Minority phase growth, coalescence, and droplet motions are observed using holographic microscopy which is capable of recording particle densities up to 10 to the 7th particles/cu cm and is able to resolve particles as small as 2 to 3 microns in diameter throughout the entire volume of the test cell. Sequential holograms allow determination of droplet size distribution changes throughout the total volume with respect to time and temperature. This allows a direct method for testing various theories of droplet growth and ripening phenomena.
Witherow, W. K.↗
Kinetic theory of dense-fluid mixtures. IV.
Kinetic prediction theory for viscosity, thermal conductivity and diffusivity of binary liquid mixtures composed of molecules interacting with square-well potential
VISCOUS FLUID↗
Evaporation of binary mixtures in microgravity
The motivation of this research is to obtain a better understanding of phase-change heat transfer within single and binary liquid meniscii, both in 1-g and 0-g environments. During phase 1 and part of phase 2, in a glass test cell with an inclined heated plate, 1-6 experiments on pentane with additions of decane up to 3% were conducted to determine the optimum concentration that will exhibit the maximum heat transfer and stability. During phase 2 emphasis was given to explore fundamental research issues and to ultimately develop a reliable capillary pumped loop (CPL) device for low gravity. In related experimental work, it was found that thermocapillary stresses near the contract line could result in a degraded wettability which ultimately could explain the observed failure of CPL devices in zero-gravity environment. Therefore, the current experimental effort investigates the effect of adding binary constituents in improving the thermocapillary characteristics near the contact line within the loop configuration. Achievements during second phase include: (1) Further enhancement of Central State University's Microgravity Laboratory by adding or improving upon capabilities of photography, video imaging, fluid visualization, and general experimental testing capabilities; (2) Experimental results for the inclined plate cell; (3) Modeling effort with a detailed scaling analysis; (4) Additional testing with a tube loop configuration to extend experimental work by Dickens, et al.; (5) Fabrication of a capillary loop to be tested using binary fluid (pentane/decane). The device that has been recently completed will be set up horizontally so that the effect of gravity on the performance is negligible. Testing will cover a wide range of parameters such as decane/pentane concentration, heat input value, heat input location (below or above meniscus), and loop temperature.
Girgis, Morris↗
Scaled equation of state parameters for gases in the critical region
In the light of recent theoretical developments, the paper presents an accurate characterization of anomalous thermodynamic behavior of xenon, helium 4, helium 3, carbon dioxide, steam and oxygen in the critical region. This behavior is associated with long range fluctuations in the system and the physical properties depend primarily on a single variable, namely, the correlation length. A description of the thermodynamic behavior of fluids in terms of scaling laws is formulated, and the two successfully used scaled equations of state (NBS equation and Linear Model parametric equation) are compared. Methods for fitting both equations to experimental equation of state data are developed and formulated, and the optimum fit for each of the two scaled equations of the above gases are presented and the results are compared. By extending the experimental data for the above one-component fluids to partially miscible binary liquids, superfluid liquid helium, ferromagnets and solids exhibiting order-disorder transitions, the principle of universality is concluded. Finally by using this principle, the critical regions for nine additional fluids are described.
Sengers, J. M. H. L.↗
The susceptibility critical exponent for a nonaqueous ionic binary mixture near a consolute point
We report turbidity measurements of a nonaqueous ionic solution of triethyl n-hexylammonium triethyl n-hexylboride in diphenyl ether. A classical susceptibility critical exponent gamma = 1.01 +/- 0.01 is obtained over the reduced temperature range t between values of 0.1 and 0.0001. The best fits of the sample transmission had a standard deviation of 0.39 percent over this range. Ising and spherical model critical exponents are firmly excluded. The correlation length amplitude xi sub 0 from fitting is 1.0 +/- 0.2 nm which is much larger than values found in neutral fluids and some aqueous binary mixtures.
Zhang, Kai C.↗
Molecular simulation of fluids with non-identical intermolecular potentials: Thermodynamic properties of 10-5 + 12-6 Mie potential binary mixtures
General methods for combining interactions between particles characterised by non-identical intermolecular potentials are investigated. The combination methods are tested by performing molecular dynamics simulations to determine the pressure, energy, isochoric and isobaric heat capacities, thermal expansion coefficient, isothermal compressibility, Joule-Thomson coefficient, and speed of sound of 10-5 + 12-6 Mie potential binary mixtures. In addition to the two non-identical Mie potentials, mixtures are also studied with non-identical intermolecular parameters. The combination methods are compared with results obtained by simply averaging the Mie exponents. When either the energy or size parameters are non-identical, very significant differences emerge in the thermodynamic properties predicted by the alternative combination methods. The isobaric heat capacity is the thermodynamic property that is most affected by the relative magnitude of the intermolecular potential parameters and the method for combining non-identical potentials. Either the arithmetic or geometric combination of potentials provides a simple and effective way of performing simulations involving mixtures of components characterised by non-identical intermolecular potentials, which is independent of their functional form.
37 INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CH↗